cell_volume         :real:0:
  0.850321543042381E+003
orbital_charges     :real:2:4,16
  0.815468394003433E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.815468394003435E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.815468394003434E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.816582704152243E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.818071879474468E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.819041894139702E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.819041894139701E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.816582704152251E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.818071879474463E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.818071879474467E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.819041894139697E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.816582704152242E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.149537501987862E+001  0.134701053283088E+001  0.134701053283088E+001
  0.134701053283088E+001  0.149795602106878E+001  0.133497466801620E+001
  0.136368640326176E+001  0.135541582975967E+001  0.149795602106878E+001
  0.135541582975968E+001  0.133497466801619E+001  0.136368640326176E+001
  0.149795602106878E+001  0.136368640326175E+001  0.135541582975967E+001
  0.133497466801619E+001
forces              :real:2:3,16
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 -0.385041794105784E-002 -0.142381071630210E-002 -0.577285190194998E-002
 -0.142381071630784E-002 -0.577285190195544E-002 -0.385041794105873E-002
 -0.555389029831191E-002  0.435683215580537E-002  0.235391125155802E-002
 -0.431629751070184E-002  0.106916830457647E-002  0.638074384249816E-002
 -0.235693747146019E-002  0.601870071394114E-002  0.413970824785331E-002
  0.413970824781183E-002 -0.235693747145642E-002  0.601870071395941E-002
  0.235391125158053E-002 -0.555389029832644E-002  0.435683215581090E-002
  0.638074384252187E-002 -0.431629751069840E-002  0.106916830457565E-002
  0.106916830458968E-002  0.638074384249596E-002 -0.431629751034480E-002
  0.601870071395764E-002  0.413970824783404E-002 -0.235693747147034E-002
  0.435683215578727E-002  0.235391125155554E-002 -0.555389029831246E-002
  0.121211034853499E-001  0.121211034851260E-001  0.121211034853345E-001
  0.994356662795302E-002 -0.106329068723286E-001 -0.124766219173966E-001
 -0.124766219173914E-001  0.994356662795422E-002 -0.106329068723563E-001
 -0.106329068723709E-001 -0.124766219173876E-001  0.994356662760766E-002
stress              :real:2:3,3
 -0.639306877303410E-004  0.711370644359038E-005  0.711370653507038E-005
  0.711370653484685E-005 -0.639306877304661E-004  0.711370644238422E-005
  0.711370644312416E-005  0.711370653458176E-005 -0.639306877302382E-004
mermin_energy       :real:0:
 -0.139962927585754E+002
end_coords          :real:2:3,16
  0.415467388016902E+001  0.333328877183078E+001  0.166323379030983E+001
  0.333328877183078E+001  0.166323379030983E+001  0.415467388016902E+001
  0.166323379030983E+001  0.415467388016902E+001  0.333328877183078E+001
  0.914844901807183E+001  0.306025164585260E+001  0.933489491117559E+001
  0.823223040414574E+001  0.472395912999654E+001  0.686439208878385E+001
  0.665104038590291E+001  0.217993902455168E+001  0.771770416154078E+001
  0.771770416154078E+001  0.665104038590291E+001  0.217993902455168E+001
  0.933489491117559E+001  0.914844901807183E+001  0.306025164585260E+001
  0.686439208878385E+001  0.823223040414574E+001  0.472395912999654E+001
  0.472395912999654E+001  0.686439208878385E+001  0.823223040414574E+001
  0.217993902455168E+001  0.771770416154078E+001  0.665104038590291E+001
  0.306025164585260E+001  0.933489491117559E+001  0.914844901807183E+001
  0.259764224746556E+001  0.259764224746556E+001  0.259764224746556E+001
  0.755541665397637E+001  0.376255012429682E+001  0.843506610390954E+001
  0.843506610390954E+001  0.755541665397637E+001  0.376255012429682E+001
  0.376255012429682E+001  0.843506610390954E+001  0.755541665397637E+001
